2-(3,5-dichlorophenyl)ethanamine

C8H9Cl2N — CID 15670830

IUPAC2-(3,5-dichlorophenyl)ethanamine
SMILESNCCc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C8H9Cl2N/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5H,1-2,11H2
InChIKeyHEEUTZAJXBKBEJ-UHFFFAOYSA-N
MW190.07 g/mol
LogP2.49
Rot. Bonds2

About 2-(3,5-dichlorophenyl)ethanamine

2-(3,5-dichlorophenyl)ethanamine (PubChem CID 15670830) has the molecular formula C8H9Cl2N and a molecular weight of 190.07 g/mol. Its IUPAC name is 2-(3,5-dichlorophenyl)ethanamine.

Molecular Properties

Compound Name2-(3,5-dichlorophenyl)ethanamine
PubChem CID15670830
Molecular FormulaC8H9Cl2N
Molecular Weight190.07 g/mol
Exact Mass189.01
IUPAC Name2-(3,5-dichlorophenyl)ethanamine
SMILESNCCc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C8H9Cl2N/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5H,1-2,11H2
InChIKeyHEEUTZAJXBKBEJ-UHFFFAOYSA-N
XLogP2.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.07
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(3,5-dichlorophenyl)pentan-1-amine
CID 158105939
2-(3,5-dichlorophenyl)ethylhydrazine
CID 53402672
3-(3-chloro-5-methylphenyl)propan-1-amine
CID 83696794
2-(5-chloro-1-oxidopyridin-1-ium-3-yl)ethanamine
CID 118162131
4-(2-aminoethyl)-2,6-dichlorophenol;hydrochloride
CID 23071601
4-(3-chloro-5-fluorophenyl)butan-1-amine
CID 114454855
2-[3-(3,5-dichlorophenoxy)phenyl]ethanamine
CID 63942155
2-(3-chloro-4,5-difluorophenyl)ethanamine
CID 117282784
2-[3-chloro-4-(3,5-dichlorophenoxy)phenyl]ethanamine
CID 81160567
2-[3-chloro-5-[4-(trifluoromethoxy)phenyl]phenyl]ethanamine
CID 134629862
1-bromo-3-(2-bromoethyl)-5-chlorobenzene
CID 174607155
3-chlorobicyclo[3.1.0]hexa-1(6),2,4-triene;ethane-1,2-diamine
CID 175219533

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenyl)ethanamine?
The IUPAC name of 2-(3,5-dichlorophenyl)ethanamine (CID 15670830) is 2-(3,5-dichlorophenyl)ethanamine.
What is the SMILES notation for 2-(3,5-dichlorophenyl)ethanamine?
The canonical SMILES for 2-(3,5-dichlorophenyl)ethanamine is NCCc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichlorophenyl)ethanamine?
The InChIKey is HEEUTZAJXBKBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9Cl2N/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5H,1-2,11H2.
What are the key properties of 2-(3,5-dichlorophenyl)ethanamine?
2-(3,5-dichlorophenyl)ethanamine has a molecular weight of 190.07 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenyl)ethanamine is sourced from PubChem (CID 15670830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).